Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.38 |
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | BCL9 | O00512 | 1/20 | 0.37 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | LSS | P48449 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL357343 | 0.80 | HSPB1 (0.52) | HSPB1CA1CA2CA9CES2 | |
| SCHEMBL10745979 | 0.80 | CA1 (0.50) | PTGS2HSPB1CA1CA2CA9 | |
| SCHEMBL3128984 | 0.78 | ALDH2 (0.36) | CA1CA2CA9ALDH1A1LMNA | |
| Methane SCHEMBL27343858 | 0.77 | TSHR (0.43) | ALDH1A1MAPTTSHRMAPK1KMT2A | |
| SCHEMBL2052557 | 0.77 | CA12 (0.54) | PTGS2HSPB1CA1CA2CA9 | |
| SCHEMBL7163998 | 0.77 | CYP3A4 (0.38) | CA1CA2CA9ALDH1A1CYP3A4 | |
| SCHEMBL5409494 | 0.74 | ALDH1A1 (0.54) | HSPB1CA1CA2CA9CES2 | |
| SCHEMBL9196447 | 0.71 | PTGS2 (0.68) | PTGS2CA1CA2CA9ALDH1A1 | |
| SCHEMBL9196451 | 0.71 | PTGS2 (0.68) | PTGS2CA1CA2CA9ALDH1A1 | |
| SCHEMBL9316639 | 0.71 | ALOX5 (0.54) | CES2CES1ALDH1A1LMNAMAPT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20030219467-A1 | Method for the inhibition of methanogensis | THE BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA | 2003-11-27 | — | — | US | disclosed |
| WO-2003038109-A2 | METHOD FOR THE INHIBITION OF METHANOGENESIS | THE BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) | 2003-05-08 | — | — | WO | disclosed |